3-[1-(4-methoxyphenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]-1-(4-methylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[1-(4-methoxyphenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]-1-(4-methylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-(4-methoxyphenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]-1-(4-methylpiperazin-1-yl)propan-1-one CAS Name: 3-[1-(4-methoxyphenyl)-3-methyl-5-(3-methylphenoxy)-4-pyrazolyl]-1-(4-methyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[1-(4-methoxyphenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]-1-(4-methylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-(4-methoxyphenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]-1-(4-methylpiperazino)propan-1-one Formula: C26H32N4O3 MolecularWeight: 448.55728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=C(C(=NN2C3=CC=C(C=C3)OC)C)CCC(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=CC(=CC=C1)OC2=C(C(=NN2C3=CC=C(C=C3)OC)C)CCC(=O)N4CCN(CC4)C

InChI

InChI=1S/C26H32N4O3/c1-19-6-5-7-23(18-19)33-26-24(12-13-25(31)29-16-14-28(3)15-17-29)20(2)27-30(26)21-8-10-22(32-4)11-9-21/h5-11,18H,12-17H2,1-4H3